Vitas-M small molecule compound
3-(3,4-dimethylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL031368
SMILES O=C(N1CCCC1)CSc1nc2ccsc2c(=O)n1c1ccc(c(c1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H21N3O2S2 MW 399.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S2/c1-13-5-6-15(11-14(13)2)23-19(25)18-16(7-10-26-18)21-20(23)27-12-17(24)22-8-3-4-9-22/h5-7,10-11H,3-4,8-9,12H2,1-2H3InChIKey
OPJLSZSTHKAGKJ-UHFFFAOYSA-NSynonyms
3(34dimethylphenyl)2((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)thieno(32d)pyrimidin4(3H)one
3(34dimethylphenyl)2(2oxo2pyrrolidin1ylethyl)sulfanylthieno(32d)pyrimidin4one
CC1=C(C=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)N4CCCC4)C
InChI=1SC20H21N3O2S2c1135615(1114(13)2)2319(25)1816(7102618)2120(23)271217(24)22834922h571011H348912H212H3
MFCD18191420
ZINC000057428442
ZINC57428442
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